bulk:  Cu fcc 3.62
subst:  Mg 1.51011430257
v1: 5929.741
n1: 500
v1pa: 11.859482
ene0: -1770.0
ene0pa: -3.54
subst n: 12
ene1nm: -1766.2055
ene1nmf: 1.76461430257
ene2m: -1766.862
ene2mf: 1.10811430257
ene3v: -1766.8687
ene3vf: 1.10141430257
esubf: 1.10141430257
V4: 5939.38742482
vintf:  21.5059068229
vintfr:  1.81339343682
